SCHEMBL25670574

SCHEMBL25670574

COc1cc(C)cc2c(C(C)(C)C)ncnc12

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 2/20 0.38
▸ PDE5A O76074 2/20 0.37
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HTT P42858 2/20 0.33
▸ RET P07949 1/20 0.33
▸ KIF5B P33176 1/20 0.33
▸ KDR P35968 1/20 0.33
▸ EGFR P00533 4/20 0.32
▸ PDE1B Q01064 2/20 0.32
▸ CSF1R P07333 2/20 0.32
▸ RIPK2 O43353 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ NOD1 Q9Y239 1/20 0.31
▸ KDM4E B2RXH2 3/20 0.31
▸ MAPK1 P28482 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24067435 0.85 PDE5A (0.41) PDE5AMEN1KMT2AMAPTALDH1A1
SCHEMBL12775449 0.79 PDE5A (0.62) PDE5APDE1B
SCHEMBL27046488 0.76 ACHE (0.41) ACHEPDE5AMEN1KMT2AMAPT
SCHEMBL25670576 0.75 HTR1A (0.46) PDE5AMEN1KMT2AEGFR
SCHEMBL10203311 0.72 EGFR (0.50) ACHERETKIF5BKDREGFR
SCHEMBL12775446 0.72 PDE1B (0.51) PDE5AMEN1KMT2AMAPTALDH1A1
SCHEMBL24067423 0.71 KDM4E (0.40) PDE5AMEN1KMT2AMAPTALDH1A1
SCHEMBL25791601 0.69 ACHE (0.40) ACHEMEN1KMT2AMAPTALDH1A1
SCHEMBL10257047 0.69 CCR1 (0.48) ACHEMEN1KMT2AMAPTALDH1A1
SCHEMBL25670579 0.69 PDE5A (0.36) PDE5APDE1B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-25 — — US disclosed
US-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2023-07-18 — — US disclosed
US-20230190927-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE CYANA THERAPEUTICS LLC 2023-06-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11701371-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 ACHE 2039/4885PDE5A 494/4885MEN1 565/4885
US-20230190927-A1 ENPP1 INHIBITORS AND METHODS OF MODULATING IMMUNE RESPONSE ENPP1, STING1, ENPP3 ACHE 574/4885PDE5A 150/4885MEN1 481/4885
US-11707471-B2 ENPP1 inhibitors and their use for the treatment of cancer ENPP1, ENPP3, ENTPD1 ACHE 2039/4885PDE5A 494/4885MEN1 565/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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